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3-Bromo-5-isobutoxybenzoic acid

Base Information Edit
  • Chemical Name:3-Bromo-5-isobutoxybenzoic acid
  • CAS No.:1228956-99-7
  • Molecular Formula:C11H13BrO3
  • Molecular Weight:273.126
  • Hs Code.:2918990090
  • DSSTox Substance ID:DTXSID30681821
  • Wikidata:Q82605984
  • Mol file:1228956-99-7.mol
3-Bromo-5-isobutoxybenzoic acid

Synonyms:3-BROMO-5-ISOBUTOXYBENZOIC ACID;1228956-99-7;3-bromo-5-(2-methylpropoxy)benzoic acid;3-bromo-5-isobutoxy-benzoic acid;SCHEMBL2176490;DTXSID30681821;RSRVOTBVNZYOKD-UHFFFAOYSA-N;MFCD16618943;3-BROMO-5-ISOBUTOXYBENZOICACID;AKOS015834275;BS-19542

Suppliers and Price of 3-Bromo-5-isobutoxybenzoic acid
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
  • TRC
  • 3-Bromo-5-isobutoxybenzoicacid
  • 1g
  • $ 75.00
  • TRC
  • 3-Bromo-5-isobutoxybenzoicacid
  • 250mg
  • $ 55.00
  • Crysdot
  • 3-Bromo-5-isobutoxybenzoicacid 95+%
  • 25g
  • $ 677.00
  • Crysdot
  • 3-Bromo-5-isobutoxybenzoicacid 95+%
  • 10g
  • $ 384.00
  • AK Scientific
  • 3-Bromo-5-isobutoxybenzoicacid
  • 5g
  • $ 371.00
Total 3 raw suppliers
Chemical Property of 3-Bromo-5-isobutoxybenzoic acid Edit
Chemical Property:
  • PSA:46.53000 
  • LogP:3.18210 
  • Storage Temp.:Room temperature. 
  • XLogP3:3.4
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:4
  • Exact Mass:272.00481
  • Heavy Atom Count:15
  • Complexity:218
Purity/Quality:

≥95% *data from raw suppliers

3-Bromo-5-isobutoxybenzoicacid *data from reagent suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC(C)COC1=CC(=CC(=C1)C(=O)O)Br
Technology Process of 3-Bromo-5-isobutoxybenzoic acid

There total 6 articles about 3-Bromo-5-isobutoxybenzoic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:
Guidance literature:
3-bromo-5-isobutoxy-benzoic acid isobutyl ester; With methanol; sodium hydroxide; at 50 ℃; for 2h;
With hydrogenchloride; In water;
Guidance literature:
Multi-step reaction with 5 steps
1: sodium hydrogencarbonate; sodium hydroxide / 1,4-dioxane; water / 12 h / 20 °C
2: potassium carbonate / N,N-dimethyl-formamide / 12 h / 40 - 50 °C
3: trifluoroacetic acid / dichloromethane / 12 h / 20 °C
4: copper(I) bromide; sodium nitrite; hydrogen bromide / ethanol; water / 0.33 h / 0 - 90 °C
5: sodium hydroxide; methanol / 2 h / 50 °C
With methanol; hydrogen bromide; sodium hydrogencarbonate; potassium carbonate; trifluoroacetic acid; copper(I) bromide; sodium hydroxide; sodium nitrite; In 1,4-dioxane; ethanol; dichloromethane; water; N,N-dimethyl-formamide;
Guidance literature:
Multi-step reaction with 2 steps
1: copper(I) bromide; sodium nitrite; hydrogen bromide / ethanol; water / 0.33 h / 0 - 90 °C
2: sodium hydroxide; methanol / 2 h / 50 °C
With methanol; hydrogen bromide; copper(I) bromide; sodium hydroxide; sodium nitrite; In ethanol; water;
Refernces Edit
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